SCHEMBL3869925

SCHEMBL3869925

CCC(N)C(O)c1nc(C(C)C)no1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
VSIR Q9H7M9 2/20 0.31
CD274 Q9NZQ7 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3869930 1.00 GPR119 (0.33) GPR119KDM4EMAPK1TDP1VSIR
SCHEMBL8294630 1.00 GPR119 (0.33) GPR119KDM4EMAPK1TDP1VSIR
SCHEMBL5385277 0.79 KDM4E (0.33) KDM4EMAPK1TDP1
SCHEMBL5460270 0.79 KDM4E (0.33) KDM4EMAPK1TDP1
SCHEMBL5385281 0.79 KDM4E (0.33) KDM4EMAPK1TDP1
SCHEMBL15932016 0.78 GPR119 (0.33) GPR119VSIRCD274MAOAMAOB
SCHEMBL5388113 0.78 PIK3CG (0.33) KDM4EMAPK1TDP1
SCHEMBL5388110 0.78 PIK3CG (0.33) KDM4EMAPK1TDP1
SCHEMBL5388859 0.78 PIK3CG (0.33) KDM4EMAPK1TDP1
SCHEMBL1091056 0.75 GPR119 (0.43) GPR119VSIRCD274MAOAMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7482448-B2 Compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2009-01-27 US disclosed
US-20060189657-A1 Novel compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2006-08-24 US disclosed
EP-1682524-A1 NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS Aventis Pharmaceuticals, Inc. (US) 2006-07-26 EP disclosed
WO-2005040142-A9 NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS AVENTIS PHARMA INC (US) 2005-06-09 WO disclosed
WO-2005040142-A1 NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2005-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060189657-A1 Novel compounds and compositions as cathepsin inhibitors CTSB, CTSS, CTSK GPR119 3464/4885KDM4E 3669/4885MAPK1 3462/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.